Vitas-M small molecule compound
(12aS)-2-(2-chlorobenzyl)-6-(3,4,5-trimethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL537942
SMILES COc1cc(cc(c1OC)OC)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1ccccc1Cl
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C30H28ClN3O5 MW 546.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28ClN3O5/c1-37-24-12-18(13-25(38-2)29(24)39-3)28-27-20(19-9-5-7-11-22(19)32-27)14-23-30(36)33(16-26(35)34(23)28)15-17-8-4-6-10-21(17)31/h4-13,23,28,32H,14-16H2,1-3H3/t23-,28?/m0/s1InChIKey
WNVBSENCDNHGSA-UHFKCPIBSA-NSynonyms
956961-23-2(12aS)2(2chlorobenzyl)6(345trimethoxyphenyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(12aS)2(2chlorobenzyl)6(345trimethoxyphenyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))6((2chlorophenyl)methyl)2(345trimethoxyphenyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16401329
956961232
COc1cc(cc(c1OC)OC)C1N2C(=O)CN(C(=O)(C@@H)2Cc2c1(nH)c1c2cccc1)Cc1ccccc1Cl
InChI=1SC30H28ClN3O5c137241218(1325(382)29(24)393)282720(199571122(19)3227)142330(36)33(1626(35)34(23)28)15178461021(17)31h413232832H1416H213H3t2328?m0s1
MFCD05674070
ZINC000002117949
ZINC000002117952
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